6-chloranyl-N-[(E)-(4-fluorophenyl)methylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: 6-chloranyl-N-[(E)-(4-fluorophenyl)methylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: 6-chloro-N-[(E)-(4-fluorophenyl)methyleneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: 6-chloro-N-[(E)-(4-fluorophenyl)methylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: 6-chloro-N-[(E)-(4-fluorophenyl)methylideneamino]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (6-chloro-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-[(E)-(4-fluorobenzylidene)amino]amine Formula: C12H8ClFN6 MolecularWeight: 290.683523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NNC2=NC(=NC3=C2C=NN3)Cl)F

Isomeric SMILES

C1=CC(=CC=C1/C=N/NC2=NC(=NC3=C2C=NN3)Cl)F

InChI

InChI=1S/C12H8ClFN6/c13-12-17-10(9-6-16-20-11(9)18-12)19-15-5-7-1-3-8(14)4-2-7/h1-6H,(H2,16,17,18,19,20)/b15-5+